CS-1163574
3-(2-Chloro-4-methylphenyl)-5-methylisoxazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2137689-70-2
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₀ClNO₃
Molecular Weight
251.67
Synonyms
None
SMILES
O=C(O)C=1C(=NOC1C)C=2C=CC(=CC2Cl)C
Tpsa
63.33
Logp
3.31004
H Acceptors
3
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀ClNO₃
Molecular Weight: 251.67
Synonyms: None
SMILES: O=C(O)C=1C(=NOC1C)C=2C=CC(=CC2Cl)C
Tpsa: 63.33
Logp: 3.31004
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀ClNO₃
Molecular Weight:
251.67
Synonyms:
None
SMILES:
O=C(O)C=1C(=NOC1C)C=2C=CC(=CC2Cl)C
Tpsa:
63.33
Logp:
3.31004
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₈F₃N₃O
Molecular Weight: 183.13
Synonyms: None
SMILES: FC(F)(F)C1(O)CN(C(=N)N)C1
Tpsa: 73.34
Logp: -0.51113
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈F₃N₃O
Molecular Weight:
183.13
Synonyms:
None
SMILES:
FC(F)(F)C1(O)CN(C(=N)N)C1
Tpsa:
73.34
Logp:
-0.51113
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₂F₃NO₂S
Molecular Weight: 313.38
Synonyms: None
SMILES: O=C(OCC(F)(F)F)N1CCCCC1CSC(C)(C)C
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₂F₃NO₂S
Molecular Weight:
313.38
Synonyms:
None
SMILES:
O=C(OCC(F)(F)F)N1CCCCC1CSC(C)(C)C
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅N₃O₂
Molecular Weight: 233.27
Synonyms: None
SMILES: O=C(OC)C1=CC=CN2C1=NN=C2CC(C)C
Tpsa: 56.49
Logp: 1.7144
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅N₃O₂
Molecular Weight:
233.27
Synonyms:
None
SMILES:
O=C(OC)C1=CC=CN2C1=NN=C2CC(C)C
Tpsa:
56.49
Logp:
1.7144
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3